chempirical

N-(2,6-Dimethylphenyl)hydrazinecarbothioamide

C9H13N3SCAS 71058-35-0195.28 g/mol

Open in Covalent MOL file
NHSNHH2N
Primary amineThiol

Properties

Molecular formula
C9H13N3S
Molar mass
195.28 g/mol
Exact mass
195.0830 Da
Melting point
204 °C
logP
1.68Crippen estimate
Polar surface area
50.4 Ų
H-bond donors / acceptors
3 / 2
Rotatable bonds
1

Identifiers

CAS number
71058-35-0
SMILES
Cc1cccc(C)c1N=C(S)NN
InChIKey
YEOAXWBYZFHOIZ-UHFFFAOYSA-N
InChI
InChI=1S/C9H13N3S/c1-6-4-3-5-7(2)8(6)11-9(13)12-10/h3-5H,10H2,1-2H3,(H2,11,12,13)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • Hydrazinecarbothioamide, N-(2,6-dimethylphenyl)-
  • 4-(2,6-Dimethylphenyl)thiosemicarbazide
  • 1-Amino-3-(2,6-dimethylphenyl)thiourea
  • 4-(2,6-Dimethylphenyl)-3-thiosemicarbazide
  • 3-Amino-1-(2,6-dimethylphenyl)thiourea

Work with N-(2,6-Dimethylphenyl)hydrazinecarbothioamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-(2-Methylphenyl)hydrazinecarbothioamide614-10-868 % similar 4-Phenylthiosemicarbazide5351-69-953 % similar N-(2-Methoxyphenyl)hydrazinecarbothioamide40207-02-146 % similar N-(2,6-Dimethylphenyl)acetamide2198-53-046 % similar Tocainide41708-72-943 % similar N,N′-Bis(2-methylphenyl)thiourea137-97-341 % similar 2-Chloro-N-(2,6-dimethylphenyl)acetamide1131-01-741 % similar 4-Benzylthiosemicarbazide13431-41-941 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

N-[4-(Dimethylamino)phenyl]thiourea22283-43-8

Elsewhere

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